Vitas-M small molecule compound
N-{(7S)-10-[(2,2-dimethyltetrahydro-2H-pyran-4-yl)amino]-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide
Catalog ID
STL525816
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NC2CCOC(C2)(C)C)NC(=O)C)cc(c1OC)OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H36N2O6 MW 496.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O6/c1-16(31)29-21-9-7-17-13-24(33-4)26(34-5)27(35-6)25(17)19-8-10-22(23(32)14-20(19)21)30-18-11-12-36-28(2,3)15-18/h8,10,13-14,18,21H,7,9,11-12,15H2,1-6H3,(H,29,31)(H,30,32)/t18?,21-/m0/s1InChIKey
UKCIZDHVNHWZBT-ZYZRXSCRSA-NSynonyms
1212475-97-2~(N)((7~(S))10((22dimethyloxan4yl)amino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1212475972
16396505
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NC2CCOC(C2)(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC28H36N2O6c116(31)292197171324(334)26(345)27(356)25(17)1981022(23(32)1420(19)21)301811123628(23)1518h81013141821H79111215H216H3(H2931)(H3032)t18?21m0s1
MFCD01881326
N((7S)10((22dimethyltetrahydro2Hpyran4yl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000008762137
ZINC000012658591
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